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CHEBI:125055 - (1S,5R)-7-[4-(3-methoxyphenyl)phenyl]-3-[(1-methyl-4-imidazolyl)sulfonyl]-3,6-diazabicyclo[3.1.1]heptane

ChEBI IDCHEBI:125055
ChEBI Name(1S,5R)-7-[4-(3-methoxyphenyl)phenyl]-3-[(1-methyl-4-imidazolyl)sulfonyl]-3,6-diazabicyclo[3.1.1]heptane
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DownloadsMolfile
FormulaC22H24N4O3S
Net Charge0
Average Mass424.526
Monoisotopic Mass424.15691
SMILESCOc1cccc(-c2ccc(C3[C@@H]4CN(S(=O)(=O)c5cn(C)cn5)C[C@H]3N4)cc2)c1
InChIInChI=1S/C22H24N4O3S/c1-25-13-21(23-14-25)30(27,28)26-11-19-22(20(12-26)24-19)16-8-6-15(7-9-16)17-4-3-5-18(10-17)29-2/h3-10,13-14,19-20,22,24H,11-12H2,1-2H3/t19-,20+,22?
InChIKeyYKIBEPHUZNWDRX-RLAPIPATSA-N
ChEBI Ontology
Outgoing Relation(s)
(1S,5R)-7-[4-(3-methoxyphenyl)phenyl]-3-[(1-methyl-4-imidazolyl)sulfonyl]-3,6-diazabicyclo[3.1.1]heptane (CHEBI:125055) is a piperidines (CHEBI:26151)
Manual XrefsDatabases
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